SCHEMBL6668697

SCHEMBL6668697

COn1c(=O)[nH]c2cc(F)c(F)cc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 2/20 0.59
MPO P05164 4/20 0.47
XDH P47989 2/20 0.47
DAO P14920 1/20 0.41
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 5/20 0.40
HPGD P15428 3/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.38
PARG Q86W56 1/20 0.38
FEN1 P39748 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HTT P42858 1/20 0.37
PDE7A Q13946 1/20 0.36
PDE7B Q9NP56 1/20 0.36
CTSV O60911 1/20 0.36
CTSL P07711 1/20 0.36
CA12 O43570 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6797621 0.76 MPO (0.41) CA9MPOXDHDAOALDH1A1
SCHEMBL6796770 0.74 CTSV (0.51) CA9MPOXDHALDH1A1KDM4E
SCHEMBL6401448 0.74 MPO (0.70) CA9MPOXDHDAOALDH1A1
SCHEMBL6645754 0.72 ALDH1A1 (0.71) CA9MPOALDH1A1KDM4EHPGD
SCHEMBL17242517 0.69 KDM4E (0.76) ALDH1A1KDM4ELMNATP53KMT2A
SCHEMBL7653637 0.69 MPO (0.43) CA9MPOXDHDAOALDH1A1
SCHEMBL7651849 0.66 MPO (0.38) MPOXDHDAOALDH1A1KDM4E
SCHEMBL13814564 0.66 P2RY12 (0.50) MPOXDHALDH1A1KDM4EHPGD
SCHEMBL328468 0.66 KDM4E (0.49) CA9MPOXDHDAOALDH1A1
Hydrochloric Acid SCHEMBL251791 0.65 KDM4E (0.48) CA9MPOXDHDAOALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401830-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS Warner-Lambert Company LLC (US) 2004-03-31 EP disclosed
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance WARNER-LAMBERT COMPANY 2003-06-19 US disclosed
WO-2002102793-A2 QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2002-12-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030114666-A1 Having quinazolindione core structure; non-antibiotic resistance ABCC1, RPS6KA1, SIGMAR1 CA9 3346/4885MPO 2346/4885XDH 354/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.